In ZINC since | Heavy atoms | Benign functionality |
---|---|---|
August 7th, 2004 | 14 | Yes |
Type pH range | xlogP | Des A‑Pol Apolar desolvation (kcal/mol) | Des Pol Polar desolvation (kcal/mol) | H Don H-bond donors | H Acc H-bond acceptors | Chg Net charge | tPSA (Ų) | MWT Molecular weight (g/mol) | RB Rotatable bonds | DL |
---|---|---|---|---|---|---|---|---|---|---|
Ref Reference (pH 7) | 3.40 | 1.32 | -5.69 | 0 | 1 | 0 | 4 | 185.27 | 0 | ↓ |
Note Type | Comments | Provided By |
---|---|---|
mp | 52 | MolMall (formerly Molecular Diversity Preservation International) |
PUBCHEM_PATENT_ID | EP0115607A1; US4547576; US4618614; US4698351 | IBM Patent Data |